4C6D
Crystal structure of the dihydroorotase domain of human CAD bound to substrate at pH 6.0
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-09-01 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 82.080, 158.770, 61.560 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.867 - 1.298 |
| R-factor | 0.1214 |
| Rwork | 0.121 |
| R-free | 0.13350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4c6c |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.904 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.870 | 1.330 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.060 | 0.660 |
| Number of reflections | 98957 | |
| <I/σ(I)> | 17.9 | 3.6 |
| Completeness [%] | 99.7 | 97 |
| Redundancy | 7.3 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | pH 6.0 |
